(3α,5β,6α,7α)-6-Bromo-3-[(ethoxycarbonyl)oxy]-7-hydroxycholan-24-oic Acid Methyl Ester


CAS No. : 125112-74-5

(3α,5β,6α,7α)-6-Bromo-3-[(ethoxycarbonyl)oxy]-7-hydroxycholan-24-oic Acid Methyl Ester,125112-74-5
Product Details
Cat No:R021005
Molecular Formula:C28H45BrO6
Molecular Weight:557.566
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Cat No:R021005
Cas No:125112-74-5
Product-Name:(3α,5β,6α,7α)-6-Bromo-3-[(ethoxycarbonyl)oxy]-7-hydroxycholan-24-oic Acid Methyl Ester
IUPAC Name:methyl (4R)-4-[(3R,5R,6R,7S,8S,9S,10R,13R,14S,17R)-6-bromo-3-ethoxycarbonyloxy-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
InChI:InChI=1S/C28H45BrO6/c1-6-34-26(32)35-17-11-13-28(4)20-12-14-27(3)18(16(2)7-10-22(30)33-5)8-9-19(27)23(20)25(31)24(29)21(28)15-17/h16-21,23-25,31H,6-15H2,1-5H3/t16-,17-,18-,19+,20+,21+,23+,24-,25+,27-,28-/m1/s1
InChIKey:XUAVJFKSCMFOON-SZUXHNFMSA-N
SMILES:CCOC(=O)OC1CCC2(C3CCC4(C(C3C(C(C2C1)Br)O)CCC4C(C)CCC(=O)OC)C)C
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